2-Acetoxy-1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutane

HCID 21320003

Basic information

Standard SMILES
CC(=O)OC(C(Oc1ccc(Cl)cc1)n1ccnc1)C(C)(C)C
InChIKey
ZXGTTYFRMCHQNG-UHFFFAOYSA-N
Molecular formula
C17H21ClN2O3
Average molar mass
336.8 g/mol

Names & identifiers

Preferred name
2-Acetoxy-1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutane
IUPAC
[1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutan-2-yl] acetate

Names & synonyms

SCHEMBL11533501ZXGTTYFRMCHQNG-UHFFFAOYSA-N2-acetoxy-1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethyl-butane2-acetoxy-1-(4-chlorophenoxy)-1-imidazol-1-yl-3,3-dimethylbutane

Database identifiers

PubChem CID
21320003

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
53.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
23

Related reactions

3 records

Linked notes

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